Journal of the Chinese Chemical Society

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Recently Published Articles

  1. Comparative Structural, Optical, and Photoluminescence Studies of YF3:Pr, YF3:Pr@LaF3, and YF3:Pr@LaF3@SiO2 Core–Shell Nanocrystals

    Anees A. Ansari

    Version of Record online: 27 MAR 2017 | DOI: 10.1002/jccs.201700015

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    The designed YF3:Pr@LaF3@SiO2 (core-shell-SiO2) nano-crystals were prepared successfully by eco-friendly polyol based co-precipitation process, then coated with silica shell by using the sol-gel based Stober method. Surface coated core-shell nanocrystals demonstrated novel physiochemical properties, which are highly usable for photonic based bio-applications.

  2. Theoretical Study of Substituent Effects on Geometric and Spectroscopic Parameters (IR, 13C, 29Si NMR) and Energy Decomposition Analysis of the Bonding in Molybdenum Silylidyne Complexes CpMo(CO)2(≡Si-para-C6H4X)

    Hadis Ghobadi, Reza Ghiasi and Saeid Jamehbozorgi

    Version of Record online: 27 MAR 2017 | DOI: 10.1002/jccs.201600795

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    We report the substituent effect on the structures, frontier orbital analysis, and spectroscopic properties (IR, 13C, 29Si NMR) in the molybdenum silylidyne complexes CpMo(CO)2(≡Si-para-C6H4X) using MPW1PW91 quantum chemical calculations. The nature of the Mo≡Si chemical bond is explored with energy decomposition analysis and natural bond orbital analyses. The linear correlations between the properties and Hammett constants are illustrated.

  3. Solid-State Characterization of 2-[(2,6-Dichlorophenyl)amino]-Benzaldehyde: An Experimental and Theoretical Investigation

    Peng Chen, Yuanyuan Jin, Panpan Zhou, Sean Parkin, Zhifei Zhang and Sihui Long

    Version of Record online: 27 MAR 2017 | DOI: 10.1002/jccs.201600848

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    The crystal structure of 2-[(2,6-dichlorophenyl)amino]-benzaldehyde (DCABA) was determined using single-crystal X-ray diffraction. Its spectroscopic and spectrometric properties were investigated by a combination of experimental and theoretical approaches and compared with those of a variety of structurally related compounds. The full characterization of this compound can help fast and accurate identification of DCABA both in dosage forms and in the environment.

  4. Copolymerization of Carbon Dioxide and Propylene Oxide by Binary Cobalt Salen Complexes with Various Anion Groups

    Xiaoju Qin, LongChao Du, Cong Wang, Zhao Yang and Min Zhang

    Version of Record online: 27 MAR 2017 | DOI: 10.1002/jccs.201700001

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    A series of salen–Co(III)(X) complexes tethering quaternary ammonium salts were designed and synthesized for the copolymerization of CO2 with PO. In these four complexes, the complex 9, where X and Y are both 2,4-dinitrophenolate, has the highest catalytic efficiency. And the complex 9 can produce the copolymer with the highest carbonate fraction and Mn.

  5. Electrochemical Treatment of Heavy Metal-containing Wastewater with the Removal of COD and Heavy Metal Ions

    Thien-Khanh Tran, Hoang-Jyh Leu, Kuo-Feng Chiu and Chiu-Yue Lin

    Version of Record online: 27 MAR 2017 | DOI: 10.1002/jccs.201600266

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    During the electrochemical process, organic compounds were formed and pushed to the surface of the aqueous phase due to the generation of gases at the two electrodes. Nevertheless, heavy metal ions were collected at the cathode as hydroxides. The system is simple and can be used several times.